3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]methylsulfanyl]-5-methyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]methylsulfanyl]-5-methyl-1,2-thiazole-4-carbonitrile Openeye Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methylsulfanyl]-5-methyl-isothiazole-4-carbonitrile CAS Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methylthio]-5-methyl-4-isothiazolecarbonitrile IUPAC Name: 3-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methylsulfanyl]-5-methyl-1,2-thiazole-4-carbonitrile Traditional Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methylthio]-5-methyl-isothiazole-4-carbonitrile Formula: C12H7ClF3N3S2 MolecularWeight: 349.78229

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NS1)SCC2=C(C=C(C=N2)C(F)(F)F)Cl)C#N

Isomeric SMILES

CC1=C(C(=NS1)SCC2=C(C=C(C=N2)C(F)(F)F)Cl)C#N

InChI

InChI=1S/C12H7ClF3N3S2/c1-6-8(3-17)11(19-21-6)20-5-10-9(13)2-7(4-18-10)12(14,15)16/h2,4H,5H2,1H3